3420-02-8

6-Methylindole(3420-02-8) MS

Product Name6-Methylindole

CAS 3420-02-8

Molecular FormulaC9H9N

Molecular Weight131.17

InChIInChI=1S/C9H9N/c1-7-2-3-8-4-5-10-9(8)6-7/h2-6,10H,1H3

InChIKey ONYNOPPOVKYGRS-UHFFFAOYSA-N

SmilesN1C2=C(C=CC(C)=C2)C=C1

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¹HNMR

IR1

Raman

6-Methylindole(3420-02-8) MS
Mass

MS-IW-1271          
6-methylindole
C9H9N               (Mass of molecular ion:    131)

   Source Temperature: 240 °C
   Sample Temperature: 160 °C
   Reservoir, 75 eV

      39.0       1.4
      50.0       1.8
      51.0       4.7
      52.0       2.8
      62.0       1.1
      63.0       2.4
      64.0       1.7
      64.5       4.8
      65.0       5.8
      65.5       4.6
      74.0       1.0
      75.0       1.5
      76.0       1.8
      77.0      11.7
      78.0       2.2
     101.0       1.4
     102.0       4.4
     103.0       9.9
     104.0       2.2
     128.0       3.1
     129.0       2.0
     130.0     100.0
     131.0      82.7
     132.0       7.9

400 MHz in CDCl3

6-Methylindole(3420-02-8) MS

¹H NMR	399.65 MHz
C₉ H₉ N	0.05 ml : 0.5 ml CDCl₃
6-methylindole

    Assign.     Shift(ppm)

      A             7.489
      B             7.46
      C             6.927
      D             6.882
      E             6.831
      F             6.418
      G             2.410

     Hz     ppm     Int.

   2772.71   6.938    135
   2771.73   6.936    147
   2764.65   6.918    127
   2763.79   6.916    143
   2750.73   6.883    244
   2750.00   6.882    239
   2733.03   6.839    164
   2730.47   6.833    206
   2729.86   6.831    212
   2727.42   6.825    174
   2568.12   6.426    119
   2567.14   6.424    131
   2566.04   6.421    142
   2565.06   6.419    202
   2563.96   6.416    142
   2562.87   6.413    134
   2562.01   6.411    120
    963.13   2.410   1000

liquid film